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887705-27-3

887705-27-3 | 2,7-Naphthyridin-1(2H)-one, 4-phenyl-

CAS No: 887705-27-3 Catalog No: AG004B8J MDL No:

Product Description

Catalog Number:
AG004B8J
Chemical Name:
2,7-Naphthyridin-1(2H)-one, 4-phenyl-
CAS Number:
887705-27-3
Molecular Formula:
C14H10N2O
Molecular Weight:
222.2420
IUPAC Name:
4-phenyl-2H-2,7-naphthyridin-1-one
InChI:
InChI=1S/C14H10N2O/c17-14-13-8-15-7-6-11(13)12(9-16-14)10-4-2-1-3-5-10/h1-9H,(H,16,17)
InChI Key:
JIWHQPVTDQXELV-UHFFFAOYSA-N
SMILES:
O=c1[nH]cc(c2c1cncc2)c1ccccc1

Properties

Complexity:
331  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.079g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
222.247g/mol
Monoisotopic Mass:
222.079g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  

Literature

Title Journal
A three-component reaction forming naphthyridones--synthesis of lophocladine analogs. Organic letters 20111007
First total synthesis of the 2,7-naphthyridine alkaloids lophocladine a and B. Archiv der Pharmazie 20061201
Lophocladines, bioactive alkaloids from the red alga Lophocladia sp. Journal of natural products 20060401

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